SCHEMBL7533957

SCHEMBL7533957

COc1ccc(S(=O)(=O)c2c(F)c(F)c(Cl)c(F)c2F)cc1O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TUBB1 Q9H4B7 5/20 0.46
TSHR P16473 2/20 0.45
POLB P06746 1/20 0.45
MAPK1 P28482 1/20 0.45
PTGS1 P23219 4/20 0.44
APP P05067 1/20 0.40
PTGS2 P35354 4/20 0.40
ALDH1A1 P00352 3/20 0.40
MEN1 O00255 2/20 0.40
LMNA P02545 2/20 0.40
KMT2A Q03164 2/20 0.40
MAPT P10636 1/20 0.40
THRB P10828 1/20 0.40
HTT P42858 1/20 0.40
PKM P14618 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
AOX1 Q06278 1/20 0.39
ALOX5 P09917 1/20 0.38
NQO1 P15559 1/20 0.38
NQO2 P16083 1/20 0.38

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL7540061 0.94 TUBB1 (0.46) TUBB1TSHRPOLBMAPK1PTGS1
SCHEMBL7535465 0.91 TUBB1 (0.50) TUBB1TSHRPOLBMAPK1PTGS1
SCHEMBL7534356 0.86 TUBB1 (0.46) TUBB1TSHRPOLBMAPK1PTGS1
SCHEMBL7535472 0.86 KMT2A (0.48) TUBB1TSHRPOLBMAPK1PTGS1
SCHEMBL7534009 0.84 TUBB1 (0.44) TUBB1TSHRPOLBMAPK1PTGS1
SCHEMBL7536222 0.83 ALDH1A1 (0.43) TUBB1TSHRPOLBMAPK1PTGS1
SCHEMBL7534746 0.82 TUBB1 (0.45) TUBB1TSHRPOLBMAPK1PTGS1
SCHEMBL7534198 0.82 TUBB1 (0.42) TUBB1TSHRPOLBMAPK1PTGS1
SCHEMBL7535447 0.80 KMT2A (0.48) TUBB1TSHRPOLBMAPK1PTGS1
SCHEMBL7534000 0.80 TUBB1 (0.40) TUBB1TSHRPOLBMAPK1PTGS1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20020013496-A1 Benzene compounds as antiproliferative and cholesterol lowering agents AMGEN INC. 2002-01-31 US claimed
EP-1005453-A1 SUBSTITUTED BENZENE COMPOUNDS AS ANTIPROLIFERATIVE AND CHOLESTEROL LOWERING AGENTS TULARIK, INC. (US) 2000-06-07 EP claimed
WO-1999010320-A1 SUBSTITUTED BENZENE COMPOUNDS AS ANTIPROLIFERATIVE AND CHOLESTEROL LOWERING AGENTS TULARIK INC. (US) 1999-03-04 WO claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20020013496-A1 Benzene compounds as antiproliferative and cholesterol lowering agents CYP46A1, TGFB1, NR1H2 TUBB1 446/4885TSHR 4093/4885POLB 638/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.